CHEBI:183279 - 3-Cyano-5,5-dimethoxycarbonyl-N-methylisoxazolidine

ChEBI IDCHEBI:183279
ChEBI Name3-Cyano-5,5-dimethoxycarbonyl-N-methylisoxazolidine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H12N2O5
Net Charge0
Average Mass228.204
Monoisotopic Mass228.07462
SMILESCOC(=O)C1(C(=O)OC)CC(C#N)ON1C
InChIInChI=1S/C9H12N2O5/c1-11-9(7(12)14-2,8(13)15-3)4-6(5-10)16-11/h6H,4H2,1-3H3
InChIKeyOFZDFXKKNJOCHZ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS1866)
ChEBI Ontology
Outgoing Relation(s)
3-Cyano-5,5-dimethoxycarbonyl-N-methylisoxazolidine (CHEBI:183279) has functional parent α-amino acid (CHEBI:33704)
3-Cyano-5,5-dimethoxycarbonyl-N-methylisoxazolidine (CHEBI:183279) is a organonitrogen compound (CHEBI:35352)
3-Cyano-5,5-dimethoxycarbonyl-N-methylisoxazolidine (CHEBI:183279) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
dimethyl 5-cyano-2-methyl-1,2-oxazolidine-3,3-dicarboxylate
Manual XrefsDatabases
519790ChemSpider